%chk=000202958.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202958

0 1
S 1.071643 -1.619880 0.066713
O 1.947927 -2.499657 0.812936
O 0.417174 -2.072480 -1.136633
N -0.117593 -1.186241 1.240532
C -1.346435 -0.522358 0.991508
C 1.884384 -0.129035 -0.245660
C -1.865333 -0.402740 -0.310350
C -3.059045 0.299024 -0.517133
C -2.037222 0.039139 2.088188
C 3.109726 0.129509 0.379297
C 1.332518 0.810182 -1.122308
C -3.737458 0.876674 0.569807
C -3.225568 0.732401 1.860475
C -3.625263 0.429091 -1.894403
C 3.780565 1.330210 0.132701
C 2.001963 2.012755 -1.369363
C 3.224594 2.271929 -0.740857
H 0.034427 -1.478133 2.215876
H -1.384069 -0.901497 -1.156215
H -1.651357 -0.061591 3.097099
H 3.548787 -0.612479 1.057181
H 0.378288 0.609397 -1.621576
H -4.661384 1.422810 0.407648
H -3.760319 1.169054 2.704728
H -2.988223 -0.029551 -2.662740
H -4.607911 -0.061215 -1.963005
H -3.767903 1.482094 -2.173104
H 4.734622 1.531106 0.618110
H 1.571089 2.745087 -2.050798
H 3.747178 3.210096 -0.933254


%chk=000202958-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202958

0 1
S 1.096652 -1.827712 -0.115335
O 2.121609 -2.825521 0.655065
O 0.480681 -2.140254 -1.582721
N -0.428571 -1.726826 1.087163
C -1.373046 -0.692722 0.837063
C 1.903433 -0.109180 -0.195447
C -2.167515 -0.762133 -0.342426
C -3.155642 0.212397 -0.605480
C -1.570888 0.368960 1.762918
C 2.963957 0.155566 0.687518
C 1.408780 0.814012 -1.132030
C -3.359608 1.254179 0.342529
C -2.582188 1.322066 1.519591
C -4.013178 0.128684 -1.856880
C 3.560427 1.436395 0.626224
C 2.016052 2.090979 -1.171643
C 3.082954 2.399596 -0.294855
H 0.010024 -1.695888 2.025795
H -2.004632 -1.595009 -1.033916
H -0.948582 0.435776 2.664320
H 3.325974 -0.620881 1.369728
H 0.599381 0.537311 -1.814641
H -4.133837 2.008333 0.156312
H -2.752269 2.128513 2.241562
H -3.622092 -0.620394 -2.565708
H -5.052659 -0.157611 -1.606918
H -4.061293 1.102151 -2.378680
H 4.397241 1.676359 1.290406
H 1.658319 2.837123 -1.888582
H 3.550318 3.389430 -0.335531


